Vitas-M small molecule compound

methyl (2Z)-2-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]imino}-5-(2-phenylethyl)-2,3-dihydro-1,3-thiazole-4-carboxylate

Catalog ID
STL246516
SMILES COC(=O)c1[nH]/c(=N/C(=O)Cn2nnc3c(c2=O)cccc3)/sc1CCc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H19N5O4S MW 449.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O4S/c1-31-21(30)19-17(12-11-14-7-3-2-4-8-14)32-22(24-19)23-18(28)13-27-20(29)15-9-5-6-10-16(15)25-26-27/h2-10H,11-13H2,1H3,(H,23,24,28)
InChIKey
IKHWYYCQLRGISV-UHFFFAOYSA-N
Synonyms
1351698-03-7
1351698037
COC(=O)c1(nH)c(=NC(=O)Cn2nnc3c(c2=O)cccc3)sc1CCc1ccccc1
methyl(2Z)2(((4oxo123benzotriazin3(4H)yl)acetyl)imino)5(2phenylethyl)23dihydro13thiazole4carboxylate
MFCD24860576
ZINC000072402613
ZINC72402613

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Available files

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